Chemical ID: 4794810

Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C34c5ccccc5N(C4=O)CC=C)Cc6ccccc6
Chemical ID:
4794810
Name [?]:
None
SMILES [?]:
Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C34c5ccccc5N(C4=O)CC=C)Cc6ccccc6
InChi [?]:
InChI=1/C29H22N2O4/c1-3-15-30-22-12-8-7-11-21(22)29(28(30)34)24-25(32)20-16-18(2)13-14-23(20)35-26(24)27(33)31(29)17-19-9-5-4-6-10-19/h3-14,16H,1,15,17H2,2H3
InChi Info:
AuxInfo=1/0/N:28,1,27,33,32,34,19,20,31,35,18,21,3,4,26,7,29,2,30,6,17,22,5,10,8,11,13,24,16,23,15,9,14,25,12/E:(5,6)(9,10)/rA:35cCCCCCCCCOCCOCONCCCCCCCNCOCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;d13;s13;s10s15;s16;s17;d18;s19;d20;d17s21;s22;s16s23;d24;s23;s26;d27;s15;s29;s30;d31;s32;d33;d30s34;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C29H22N2O4
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:11.5425
Area:622.68
Solvation:-4.02448
Coulombic:-55.1476
Bond Count [?]
All:40
Single:26
Double:14
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:462.496
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.3
LogP (Chemaxon):4.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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